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Tungsten GAP | Tungsten GAP model files |

Tungsten Training Configurations | Tungsten training configuration files with DFT data |

Iron GAP | Iron GAP model files arXiv preprint |

Iron Training Configurations | Iron configurations with DFT data |

Water and ice | pure liquid and solid water, multiple ice phases |

Methane - Water | H_{2}O - CH_{4} dimer |

- gap_dft_corrections_water.tgz: GAP models for 1- and 2-body corrections for water taking DFT as a baseline and CCSD(T) as the target. Includes corrections to BLYP, PBE and PBE0 functionals.
- gap_dft_corrections_ch4_h2o.tgz: GAP models for 1- and 2-body corrections taking DFT as a baseline and CCSD(T) as the target
- gap_dft_1_2_body_LiH2O.tgz: gap_dft_1_2_body_LiH2O.tgz

Bulk semiconductors | Potentials for C, Si, Ge and GaN |

Training Configurations | C, Si, Ge and GaN training configurations with DFT data |

Amorphous carbon | GAP model for liquid and amorphous carbon (see arXiv preprint) |

Topic revision: r15 - 05 Jul 2017, TomDaff

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